| SpectraBase Spectrum ID |
HT8pqUi4qpM |
| Name |
Butyl Benzoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-2-3-9-13-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChIKey |
XSIFPSYPOVKYCO-UHFFFAOYSA-N |
| Instrument Name |
Thermo scientific LCQ/Agilent 5975B-7890N MSD/ GCT premier |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.joc.1c01169 |
| Molecular Weight |
178.231 g/mol |
| Reported Formula |
C11H14O2 |
| SMILES |
C(CCC)OC(c1ccccc1)=O |
| SPLASH |
splash10-0ab9-1900000000-518c148cd268da6a626d |
| Source of Spectrum |
JOC-86-11618-2b |
| Thin-Layer Chromatography |
Rf = 0.63 (hexane/EtOAc, 10:1) |
| Wiley ID |
1867928 |
